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(4S)-1-[4-[(4S)-2-keto-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one

View entire compound with spectra: 1 MS (GC)

(4S)-1-[4-[(4S)-2-keto-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one
SpectraBase Compound ID IXiztjRUmaN
InChI InChI=1S/C28H38N4O2/c33-27-21-25(23-11-3-1-4-12-23)29-15-9-19-31(27)17-7-8-18-32-20-10-16-30-26(22-28(32)34)24-13-5-2-6-14-24/h1-6,11-14,25-26,29-30H,7-10,15-22H2/t25-,26-/m0/s1
InChIKey PCRBYVNOUJIGTC-UIOOFZCWSA-N
Mol Weight 462.6 g/mol
Molecular Formula C28H38N4O2
Exact Mass 462.299476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgndV9RkNh5
Name (4S)-1-[4-[(4S)-2-keto-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38N4O2
InChI InChI=1S/C28H38N4O2/c33-27-21-25(23-11-3-1-4-12-23)29-15-9-19-31(27)17-7-8-18-32-20-10-16-30-26(22-28(32)34)24-13-5-2-6-14-24/h1-6,11-14,25-26,29-30H,7-10,15-22H2/t25-,26-/m0/s1
InChIKey PCRBYVNOUJIGTC-UIOOFZCWSA-N
Molecular Weight 462.638 g/mol
SMILES N1CCCN(CCCCN2CCCN[C@@](CC2=O)(c2ccccc2)[H])C(C[C@]1(c1ccccc1)[H])=O
SPLASH splash10-02u4-2910200000-9f9db91515661ecd30bb
Source of Spectrum AJ-68-3129-9
Synonyms (4S)-1-[4-[(4S)-2-oxidanylidene-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one (4S)-1-[4-[(4S)-2-oxo-4-phenyl-1,5-diazocan-1-yl]butyl]-4-phenyl-1,5-diazocan-2-one
Wiley ID 773318